General Information of the Compound
| Compound ID |
CP0408215
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| Compound Name |
2-[3-[4-[2-(trifluoromethyl)phenyl]phenyl]propanoylamino]benzoic acid
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| Structure |
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| Formula |
C23H18F3NO3
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| Molecular Weight |
413.395
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| Canonical SMILES |
OC(=O)c1ccccc1NC(=O)CCc1ccc(cc1)-c1ccccc1C(F)(F)F
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| InChI |
InChI=1S/C23H18F3NO3/c24-23(25,26)19-7-3-1-5-17(19)16-12-9-15(10-13-16)11-14-21(28)27-20-8-4-2-6-18(20)22(29)30/h1-10,12-13H,11,14H2,(H,27,28)(H,29,30)
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| InChIKey |
GMSKKTOXMRVRIS-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound